[1-[1-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid

Systemtic Name: [1-[1-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid Openeye Name: [1-[1-(2-amino-6-oxo-3H-purin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid CAS Name: [1-[1-(2-amino-6-oxo-3H-purin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid IUPAC Name: [1-[1-(2-amino-6-oxo-3H-purin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid Traditional Name: [1-[1-(2-amino-6-keto-3H-purin-9-yl)ethyl]cyclopropyl]methoxymethylphosphonic acid Formula: C12H18N5O5P MolecularWeight: 343.275581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CC1)COCP(=O)(O)O)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CC(C1(CC1)COCP(=O)(O)O)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C12H18N5O5P/c1-7(12(2-3-12)4-22-6-23(19,20)21)17-5-14-8-9(17)15-11(13)16-10(8)18/h5,7H,2-4,6H2,1H3,(H2,19,20,21)(H3,13,15,16,18)